Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:27:02 UTC
Update Date2025-03-21 18:39:45 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00127103
Frequency20.1
Structure
Chemical FormulaC11H8O3
Molecular Mass188.0473
SMILESO=C(Oc1ccccc1)c1ccco1
InChI KeyYYHDAWBGVZLMAD-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classphenol esters
Subclass phenol esters
Direct Parent phenol esters
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • carboxylic acid esters
  • furoic acid esters
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • organic oxides
  • organooxygen compounds
  • oxacyclic compounds
  • phenoxy compounds
  • Substituents
  • furan
  • monocyclic benzene moiety
  • furoic acid or derivatives
  • aromatic heteromonocyclic compound
  • heteroaromatic compound
  • carboxylic acid derivative
  • oxacycle
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • carboxylic acid ester
  • phenol ester
  • hydrocarbon derivative
  • phenoxy compound
  • organoheterocyclic compound
  • organooxygen compound
  • furoic acid ester